SCHEMBL6943387

SCHEMBL6943387

O=C(O)CNC(CS(=O)(=O)O)C(=O)O

nearest known ligand 0.34

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 1/20 0.32
RIMKLA Q8IXN7 1/20 0.32
NAALAD2 Q9Y3Q0 1/20 0.32
KDR P35968 1/20 0.32
ENPEP Q07075 2/20 0.32
TGFBR1 P36897 1/20 0.31
SLC22A6 Q4U2R8 1/20 0.31
MMP1 P03956 1/20 0.30
GAA P10253 1/20 0.30
MMP12 P39900 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL2132123 1.00 FOLH1 (0.32) FOLH1RIMKLANAALAD2KDRENPEP
SCHEMBL142363 0.83 GGT1 (0.36) FOLH1RIMKLANAALAD2ENPEPTGFBR1
SCHEMBL142364 0.83 GGT1 (0.36) FOLH1RIMKLANAALAD2ENPEPTGFBR1
SCHEMBL8330610 0.75 LMNA (0.36) SLC22A6
SCHEMBL8358625 0.75 FOLH1 (0.43) FOLH1RIMKLANAALAD2
SCHEMBL31515380 0.75 TGFBR1 (0.31) ENPEPTGFBR1
SCHEMBL9686357 0.75 ECE1 (0.40) ENPEP
SCHEMBL26693279 0.75 TGFBR1 (0.31) ENPEPTGFBR1
SCHEMBL13213154 0.74 SLC22A6 (0.38) FOLH1RIMKLANAALAD2ENPEPTGFBR1
SCHEMBL3661989 0.74 SLC22A6 (0.38) FOLH1RIMKLANAALAD2ENPEPTGFBR1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1276716-A2 METAL CHELATING COMPOSITIONS Sigma-Aldrich Company (US) 2003-01-22 EP disclosed
WO-2001081365-A2 METAL CHELATING COMPOSITIONS SIGMA-ALDRICH CO. (US) 2001-11-01 WO disclosed